[4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine

C19H26N2 — CID 114959925

IUPAC[4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine
SMILESCC1CCN(C(C)c2ccc3ccccc3c2)CC1CN
InChIInChI=1S/C19H26N2/c1-14-9-10-21(13-19(14)12-20)15(2)17-8-7-16-5-3-4-6-18(16)11-17/h3-8,11,14-15,19H,9-10,12-13,20H2,1-2H3
InChIKeyFGXLNDGUFIBGJE-UHFFFAOYSA-N
MW282.43 g/mol
LogP3.82
Rot. Bonds3

About [4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine

[4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine (PubChem CID 114959925) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is [4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine.

Molecular Properties

Compound Name[4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine
PubChem CID114959925
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name[4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine
SMILESCC1CCN(C(C)c2ccc3ccccc3c2)CC1CN
InChIInChI=1S/C19H26N2/c1-14-9-10-21(13-19(14)12-20)15(2)17-8-7-16-5-3-4-6-18(16)11-17/h3-8,11,14-15,19H,9-10,12-13,20H2,1-2H3
InChIKeyFGXLNDGUFIBGJE-UHFFFAOYSA-N
XLogP3.82
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[1-(4-iodophenyl)ethyl]-4-methylpiperidin-3-yl]methanamine
CID 114083156
1-(1-naphthalen-2-ylethyl)piperidin-4-amine;hydrochloride
CID 119907327
3-(1-naphthalen-2-ylethyl)-3,9-diazabicyclo[4.2.1]nonane
CID 81495302
1-(1-naphthalen-2-ylethyl)piperidine-4-carboxylic acid
CID 65054272
N-methyl-1-[1-(1-naphthalen-2-ylethyl)piperidin-4-yl]methanamine;hydrochloride
CID 119922301
N-[[1-(1-naphthalen-2-ylethyl)piperidin-4-yl]methyl]ethanamine
CID 119927809
[1-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-4-methylpiperidin-3-yl]methanamine
CID 114959869
[1-[1-[2-(difluoromethoxy)phenyl]ethyl]-4-methylpiperidin-3-yl]methanamine
CID 114959943
[1-[1-(5-bromo-2-fluorophenyl)ethyl]-4-methylpiperidin-3-yl]methanamine
CID 114959902
[4-methyl-1-[1-(4-methylphenyl)propyl]piperidin-3-yl]methanamine
CID 114960002
[4-methyl-1-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidin-3-yl]methanamine
CID 114960021
1-[(1R)-1-naphthalen-2-ylethyl]piperazine
CID 93464443

Frequently Asked Questions

What is the IUPAC name of [4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine?
The IUPAC name of [4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine (CID 114959925) is [4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine.
What is the SMILES notation for [4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine?
The canonical SMILES for [4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine is CC1CCN(C(C)c2ccc3ccccc3c2)CC1CN.
What is the InChIKey of [4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine?
The InChIKey is FGXLNDGUFIBGJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-14-9-10-21(13-19(14)12-20)15(2)17-8-7-16-5-3-4-6-18(16)11-17/h3-8,11,14-15,19H,9-10,12-13,20H2,1-2H3.
What are the key properties of [4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine?
[4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine has a molecular weight of 282.43 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(1-naphthalen-2-ylethyl)piperidin-3-yl]methanamine is sourced from PubChem (CID 114959925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).